| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
Absorption spectra of small silver clusters Ag n (n⩾3)
|
Rabin, I.
|
|
1999
|
312 |
5-6 |
p. 394-398
5 p.
|
article
|
| 2 |
Accurately solving the electronic Schrödinger equation of atoms and molecules using explicitly correlated (r 12-)MR-CI.
|
Gdanitz, Robert J.
|
|
1999
|
312 |
5-6 |
p. 578-584
7 p.
|
article
|
| 3 |
An ab initio study of DNA base pair hydrogen bonding: a comparison of plane-wave versus Gaussian-type function methods
|
Fellers, R.S
|
|
1999
|
312 |
5-6 |
p. 548-555
8 p.
|
article
|
| 4 |
An adiabatic picture for electron transfer in mixed-valence systems 1 This Letter is dedicated to Professor Kent Wilson. 1
|
Cao, Jianshu
|
|
1999
|
312 |
5-6 |
p. 606-612
7 p.
|
article
|
| 5 |
An application of the rotating line umbrella model to quantum dynamics of S N 2 reactions
|
Yu, Hua-Gen
|
|
1999
|
312 |
5-6 |
p. 585-590
6 p.
|
article
|
| 6 |
Angular geometry, binding strength and charge transfer for the complex H2S⋯ICl determined by rotational spectroscopy
|
Legon, A.C.
|
|
1999
|
312 |
5-6 |
p. 385-393
9 p.
|
article
|
| 7 |
A theoretical base for optimising intermolecular interactions driving polarity formation in channel-type host–guest materials
|
Quintel, Andrea
|
|
1999
|
312 |
5-6 |
p. 567-571
5 p.
|
article
|
| 8 |
A tier model calculation of the absorption spectrum of the fourth CH stretch overtone state CH(v=5) in benzene
|
Rashev, S.
|
|
1999
|
312 |
5-6 |
p. 561-566
6 p.
|
article
|
| 9 |
Connectivity polynomial and long-range contributions in the molecular connectivity model
|
Estrada, Ernesto
|
|
1999
|
312 |
5-6 |
p. 556-560
5 p.
|
article
|
| 10 |
Decomposition of exchange-correlation energies
|
Gilbert, Andrew T.B.
|
|
1999
|
312 |
5-6 |
p. 511-521
11 p.
|
article
|
| 11 |
Erratum
|
|
|
1999
|
312 |
5-6 |
p. 617-
1 p.
|
article
|
| 12 |
Erratum
|
|
|
1999
|
312 |
5-6 |
p. 613-616
4 p.
|
article
|
| 13 |
Exposure mechanism of fullerene derivative electron beam resists
|
Robinson, A.P.G
|
|
1999
|
312 |
5-6 |
p. 469-474
6 p.
|
article
|
| 14 |
Femtosecond dynamics of ground-state vibrational motion and energy flow: polymers of diacetylene
|
Vierheilig, A
|
|
1999
|
312 |
5-6 |
p. 349-356
8 p.
|
article
|
| 15 |
Hole burning properties of aluminum phthalocyanine tetrasulphonate in water-containing poly(2-hydroxyethyl methacrylate) films
|
Hayes, J.M
|
|
1999
|
312 |
5-6 |
p. 362-368
7 p.
|
article
|
| 16 |
Index
|
|
|
1999
|
312 |
5-6 |
p. 618-626
9 p.
|
article
|
| 17 |
Investigation of the solvatochromic electronic transitions of [Ru(NH3)4bipyridine]2+
|
Streiff, John H.
|
|
1999
|
312 |
5-6 |
p. 369-375
7 p.
|
article
|
| 18 |
Magnetic-field effect on the micellar surface-bound benzophenone tetracarboxylic acid–sodium salt in aqueous cetyltrimethylammonium bromide medium
|
Haldar, Mintu
|
|
1999
|
312 |
5-6 |
p. 432-439
8 p.
|
article
|
| 19 |
Mapping molecular dynamics (Na2) in intense laser fields: another dimension to femtochemistry
|
Frohnmeyer, T.
|
|
1999
|
312 |
5-6 |
p. 447-454
8 p.
|
article
|
| 20 |
Measurement of the nonlinear refractive index n 2 of electronically excited terthiophene
|
Helbig, M.
|
|
1999
|
312 |
5-6 |
p. 415-421
7 p.
|
article
|
| 21 |
Mode specific vibrational kinetics after intramolecular electron transfer studied by picosecond anti-Stokes Raman spectroscopy
|
Hogiu, S
|
|
1999
|
312 |
5-6 |
p. 407-414
8 p.
|
article
|
| 22 |
Molecular-beam study of the adsorption and desorption of hydrogen sulfide on Ag{111}
|
Yu, Y
|
|
1999
|
312 |
5-6 |
p. 455-460
6 p.
|
article
|
| 23 |
Non-exponential relaxation of a single quantum vibrational excitation of a large molecule in collision free gas phase at elevated temperature
|
Myers, D.J.
|
|
1999
|
312 |
5-6 |
p. 399-406
8 p.
|
article
|
| 24 |
Optical absorptions of the X-center-type sodium nanoclusters in the gas-aggregation technique with a reactant nozzle
|
Sanekata, Masaomi
|
|
1999
|
312 |
5-6 |
p. 422-431
10 p.
|
article
|
| 25 |
Origin of the unusual stability of MnO4 −
|
Gutsev, Gennady L
|
|
1999
|
312 |
5-6 |
p. 598-605
8 p.
|
article
|
| 26 |
Perturbative inversion of the HOCl potential energy surface via singular value decomposition
|
Skokov, Sergei
|
|
1999
|
312 |
5-6 |
p. 494-502
9 p.
|
article
|
| 27 |
Prediction of a nanoporous sp2-carbon framework structure by combining graph theory with quantum mechanics
|
Winkler, Björn
|
|
1999
|
312 |
5-6 |
p. 536-541
6 p.
|
article
|
| 28 |
Quantum anharmonic frequencies of the O⋯ H⋯ O fragment of the H5O2 + ion: a model three-dimensional study
|
Vener, M.V.
|
|
1999
|
312 |
5-6 |
p. 591-597
7 p.
|
article
|
| 29 |
Quantum dynamics of intramolecular vibrational energy redistribution for initally excited CC ring modes in 30-mode benzene
|
Minehardt, Todd J.
|
|
1999
|
312 |
5-6 |
p. 485-493
9 p.
|
article
|
| 30 |
Rate-equation theory of azobenzene monolayer photoisomerization
|
Zhao, Wei
|
|
1999
|
312 |
5-6 |
p. 572-577
6 p.
|
article
|
| 31 |
Resonant chaos control by light in a chemiluminescent reaction
|
Guderian, A
|
|
1999
|
312 |
5-6 |
p. 440-446
7 p.
|
article
|
| 32 |
Rotational spectrum, structure and modeling of an isomer of the HCCH–OCS dimer
|
Peebles, Sean A
|
|
1999
|
312 |
5-6 |
p. 357-361
5 p.
|
article
|
| 33 |
Study of correlations for dihydrogen bonds by quantum-chemical calculations
|
Grabowski, Stawomir J
|
|
1999
|
312 |
5-6 |
p. 542-547
6 p.
|
article
|
| 34 |
Synthesis of aligned carbon nanotubes using thermal chemical vapor deposition
|
Lee, Cheol Jin
|
|
1999
|
312 |
5-6 |
p. 461-468
8 p.
|
article
|
| 35 |
The dynamics of gain-narrowing in a ladder-type π-conjugated polymer
|
Wegmann, G.
|
|
1999
|
312 |
5-6 |
p. 376-384
9 p.
|
article
|
| 36 |
Theoretical calculations of thermal rate constants for the N( 2 D )+acetylene reaction
|
Takayanagi, Toshiyuki
|
|
1999
|
312 |
5-6 |
p. 503-510
8 p.
|
article
|
| 37 |
Theoretical study of vibrational spectra for Cl−(H2O): temperature dependence and the influence of Ar n (n=1–3)
|
Satoh, Katsuhiko
|
|
1999
|
312 |
5-6 |
p. 522-529
8 p.
|
article
|
| 38 |
Toward coupled-cluster accuracy in the prediction of nuclear shielding constants: a simple and efficient DFT approach
|
Wilson, Philip J.
|
|
1999
|
312 |
5-6 |
p. 475-484
10 p.
|
article
|
| 39 |
Vibrational–rotational energy transfer in H2–H2 collisions
|
Zenevich, Vladimir A.
|
|
1999
|
312 |
5-6 |
p. 530-535
6 p.
|
article
|
Journal description